<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">348408</id>
  <title nil="true"/>
  <common-name>2-[(dibenzylamino)methyl]-1-(3-methoxyphenyl)cyclohexan-1-ol</common-name>
  <description>2-[(dibenzylamino)methyl]-1-(3-methoxyphenyl)cyclohexan-1-ol is a chemical compound with the formula C28H33NO2. It has an average molecular weight of 415.60 g/mol.</description>
  <cas>745009-38-5</cas>
  <pubchem-id>3050310</pubchem-id>
  <chemical-formula>C28H33NO2</chemical-formula>
  <weight>415.6</weight>
  <appearance nil="true"/>
  <melting-point nil="true"/>
  <boiling-point nil="true"/>
  <density nil="true"/>
  <solubility nil="true"/>
  <specific-gravity nil="true"/>
  <flash-point nil="true"/>
  <vapour-pressure nil="true"/>
  <route-of-exposure nil="true"/>
  <target nil="true"/>
  <mechanism-of-toxicity nil="true"/>
  <metabolism nil="true"/>
  <toxicity nil="true"/>
  <lethaldose nil="true"/>
  <carcinogenicity nil="true"/>
  <use-source nil="true"/>
  <min-risk-level nil="true"/>
  <health-effects nil="true"/>
  <symptoms nil="true"/>
  <treatment nil="true"/>
  <created-at type="dateTime">2026-08-31T12:25:33Z</created-at>
  <updated-at type="dateTime">2026-08-31T12:25:33Z</updated-at>
  <interacting-proteins nil="true"/>
  <wikipedia nil="true"/>
  <uniprot-id nil="true"/>
  <kegg-compound-id nil="true"/>
  <omim-id nil="true"/>
  <chebi-id nil="true"/>
  <biocyc-id nil="true"/>
  <ctd-id nil="true"/>
  <stitch-id nil="true"/>
  <drugbank-id nil="true"/>
  <pdb-id nil="true"/>
  <actor-id nil="true"/>
  <organism nil="true"/>
  <export type="boolean">true</export>
  <metabolizing-proteins nil="true"/>
  <transporting-proteins nil="true"/>
  <moldb-smiles>COC1=CC=CC(=C1)C2(CCCCC2CN(CC3=CC=CC=C3)CC4=CC=CC=C4)O</moldb-smiles>
  <moldb-formula>C28H33NO2</moldb-formula>
  <moldb-inchi>InChI=1S/C28H33NO2/c1-31-27-17-10-16-25(19-27)28(30)18-9-8-15-26(28)22-29(20-23-11-4-2-5-12-23)21-24-13-6-3-7-14-24/h2-7,10-14,16-17,19,26,30H,8-9,15,18,20-22H2,1H3</moldb-inchi>
  <moldb-inchikey>UUCCCVCIZKKOEK-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">415.2511293</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>5.6</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id nil="true"/>
  <structure-image-file-name nil="true"/>
  <structure-image-content-type nil="true"/>
  <structure-image-file-size type="integer" nil="true"/>
  <structure-image-updated-at type="dateTime" nil="true"/>
  <biodb-id nil="true"/>
  <synthesis-reference nil="true"/>
  <structure-image-caption nil="true"/>
  <chemdb-id>CHEM344301</chemdb-id>
  <dsstox-id nil="true"/>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id nil="true"/>
  <iupac>2-[(dibenzylamino)methyl]-1-(3-methoxyphenyl)cyclohexan-1-ol</iupac>
  <moldb-polar-surface-area nil="true"/>
  <moldb-refractivity nil="true"/>
  <moldb-polarizability nil="true"/>
  <moldb-rotatable-bond-count nil="true"/>
  <moldb-acceptor-count nil="true"/>
  <moldb-donor-count nil="true"/>
  <moldb-pka-strongest-acidic nil="true"/>
  <moldb-pka-strongest-basic nil="true"/>
  <moldb-physiological-charge nil="true"/>
  <moldb-number-of-rings nil="true"/>
  <moldb-alogps-logp nil="true"/>
  <moldb-alogps-logs nil="true"/>
  <moldb-alogps-solubility nil="true"/>
  <kingdom>Organic compounds</kingdom>
  <superklass>Benzenoids</superklass>
  <klass>Benzene and substituted derivatives</klass>
  <subklass>Phenylmethylamines</subklass>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0298743</sync-id>
  <structure-inchikey>UUCCCVCIZKKOEK-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>800000000000001002000000020000000000000000100000000000000000200000000000000004000000000000000000000000000010000000000008200000000000000000000000000000000100000000000000000008040000018000002040000000104020000000020000080000000000001000100801000048200000800020000000001020200000000100000040000000000000000000000004000000000000080000000000000000000000000000000000000080000000000000000000000802000000000000000000000000000220000040000000000000000000000040000020000000000000000008000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAfAAAAIgAAAIABBgBgAAAAAQMIACgAAAAD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</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T05:46:47Z</structure-indexed-at>
</compound>
